Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3jaf_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 5.A N ALA 1.A O no hydrogen 3.107 N/A LEU 6.A N PRO 2.A O no hydrogen 3.496 N/A ASP 7.A N SER 3.A O no hydrogen 2.909 N/A LYS 8.A N PHE 5.A O no hydrogen 3.237 N/A LEU 9.A N PHE 5.A O no hydrogen 2.919 N/A MET 10.A N LEU 6.A O no hydrogen 3.160 N/A GLY 15.A N LYS 12.A O no hydrogen 2.886 N/A ARG 19.A N ASP 17.A OD1 no hydrogen 3.176 N/A VAL 29.A N ASP 157.A O no hydrogen 2.986 N/A VAL 31.A N ILE 159.A O no hydrogen 3.038 N/A THR 32.A N GLN 59.A O no hydrogen 2.895 N/A THR 32.A OG1 GLN 59.A O no hydrogen 3.423 N/A THR 32.A OG1 GLN 59.A OE1 no hydrogen 3.354 N/A CYS 33.A N GLU 161.A O no hydrogen 3.235 N/A ASN 34.A N ARG 57.A O no hydrogen 2.858 N/A ILE 35.A N ALA 167.A O no hydrogen 2.962 N/A PHE 36.A N PHE 55.A O no hydrogen 2.921 N/A ILE 37.A N GLN 169.A O no hydrogen 2.922 N/A ASN 38.A N ASN 53.A O no hydrogen 2.934 N/A SER 39.A N ASN 53.A OD1 no hydrogen 3.242 N/A SER 39.A OG ASN 53.A OD1 no hydrogen 3.044 N/A GLY 41.A N ARG 51.A O no hydrogen 2.883 N/A SER 42.A OG GLY 41.A O no hydrogen 2.655 N/A ALA 44.A N ASP 49.A O no hydrogen 3.506 N/A THR 46.A OG1 SER 265.A O no hydrogen 2.643 N/A MET 48.A N ALA 44.A O no hydrogen 2.934 N/A TYR 50.A N LEU 128.A O no hydrogen 2.884 N/A ARG 51.A N GLY 41.A O no hydrogen 3.112 N/A VAL 52.A N LEU 126.A O no hydrogen 2.905 N/A ILE 54.A N ILE 124.A O no hydrogen 2.886 N/A PHE 55.A N PHE 36.A O no hydrogen 2.876 N/A LEU 56.A N ILE 122.A O no hydrogen 2.857 N/A ARG 57.A N ASN 34.A O no hydrogen 2.922 N/A GLN 58.A N TYR 120.A O no hydrogen 2.835 N/A GLN 58.A NE2 PRO 88.A O no hydrogen 3.686 N/A GLN 59.A N THR 32.A O no hydrogen 2.895 N/A ASN 61.A ND2 ASN 117.A OD1 no hydrogen 3.301 N/A ASP 62.A N GLY 116.A O no hydrogen 3.271 N/A ARG 64.A NE ASP 62.A OD2 no hydrogen 3.527 N/A ARG 64.A NH1 ILE 20.A O no hydrogen 2.945 N/A ARG 64.A NH2 ILE 20.A O no hydrogen 3.392 N/A ALA 66.A N PRO 63.A O no hydrogen 3.203 N/A LEU 75.A N ILE 112.A O no hydrogen 2.911 N/A SER 80.A N ASP 78.A OD2 no hydrogen 2.971 N/A SER 80.A OG ASP 78.A OD2 no hydrogen 2.307 N/A ASP 83.A N SER 80.A O no hydrogen 2.913 N/A SER 84.A N MET 81.A O no hydrogen 2.897 N/A TRP 86.A N TYR 16.A OH no hydrogen 3.009 N/A TRP 86.A NE1 TYR 153.A OH no hydrogen 3.002 N/A LYS 87.A NZ LEU 82.A O no hydrogen 2.954 N/A PHE 91.A N GLU 149.A O no hydrogen 3.003 N/A ALA 93.A N GLN 147.A O no hydrogen 3.207 N/A ASN 94.A ND2 ALA 129.A O no hydrogen 3.699 N/A ASN 94.A ND2 ILE 145.A O no hydrogen 3.079 N/A GLU 95.A N PHE 92.A O no hydrogen 3.417 N/A LYS 96.A NZ ASP 49.A OD2 no hydrogen 2.594 N/A ASN 99.A N THR 125.A O no hydrogen 2.969 N/A THR 105.A OG1 ASP 106.A O no hydrogen 3.410 N/A ASN 107.A N HIS 101.A O no hydrogen 3.380 N/A ASN 107.A ND2 VAL 103.A O no hydrogen 3.698 N/A LYS 108.A NZ ASP 83.A OD1 no hydrogen 3.411 N/A LEU 109.A N SER 121.A O no hydrogen 2.853 N/A ARG 111.A N LEU 119.A O no hydrogen 2.968 N/A ILE 112.A N LEU 75.A O no hydrogen 2.908 N/A SER 113.A N ASN 117.A O no hydrogen 2.789 N/A SER 113.A OG ASP 73.A O no hydrogen 3.344 N/A LYS 114.A N ASP 73.A O no hydrogen 2.696 N/A GLY 116.A N SER 113.A O no hydrogen 2.693 N/A VAL 118.A N TRP 60.A O no hydrogen 3.069 N/A LEU 119.A N ARG 111.A O no hydrogen 2.900 N/A TYR 120.A N GLN 58.A O no hydrogen 2.984 N/A SER 121.A N LEU 109.A O no hydrogen 2.839 N/A ILE 122.A N LEU 56.A O no hydrogen 2.958 N/A ILE 124.A N ILE 54.A O no hydrogen 2.937 N/A THR 125.A N ASN 99.A O no hydrogen 2.902 N/A THR 125.A OG1 HIS 101.A NE2 no hydrogen 2.693 N/A LEU 126.A N VAL 52.A O no hydrogen 2.882 N/A LEU 128.A N TYR 50.A O no hydrogen 2.893 N/A LEU 134.A N TYR 271.A OH no hydrogen 2.879 N/A ASP 140.A N PHE 137.A O no hydrogen 3.481 N/A GLN 142.A N LEU 208.A O no hydrogen 2.903 N/A CYS 144.A N PHE 206.A O no hydrogen 2.891 N/A MET 146.A N ALA 204.A O no hydrogen 3.470 N/A LEU 148.A N ILE 202.A O no hydrogen 2.862 N/A GLU 149.A N PHE 91.A O no hydrogen 3.166 N/A SER 150.A N THR 200.A O no hydrogen 3.176 N/A SER 150.A OG ASP 89.A O no hydrogen 3.284 N/A SER 150.A OG ASP 89.A OD1 no hydrogen 3.153 N/A THR 154.A OG1 ASN 156.A OD1 no hydrogen 2.590 N/A ASP 157.A N THR 154.A O no hydrogen 3.286 N/A LEU 158.A N THR 154.A O no hydrogen 3.146 N/A ILE 159.A N VAL 29.A O no hydrogen 2.996 N/A GLU 161.A N VAL 31.A O no hydrogen 2.858 N/A GLN 169.A N ILE 35.A O no hydrogen 2.923 N/A ALA 171.A N ILE 37.A O no hydrogen 3.328 N/A LEU 174.A N ALA 171.A O no hydrogen 3.348 N/A ILE 180.A N GLU 209.A O no hydrogen 2.914 N/A LYS 182.A N HIS 207.A O no hydrogen 3.157 N/A LYS 185.A NZ LYS 182.A O no hydrogen 3.459 N/A ARG 188.A N GLU 203.A O no hydrogen 3.027 N/A CYS 190.A N CYS 201.A O no hydrogen 3.321 N/A LYS 192.A N PHE 199.A O no hydrogen 2.955 N/A LYS 192.A NZ TYR 194.A OH no hydrogen 3.439 N/A TYR 194.A N GLY 197.A O no hydrogen 3.012 N/A PHE 199.A N LYS 192.A O no hydrogen 2.874 N/A ILE 202.A N LEU 148.A O no hydrogen 2.937 N/A GLU 203.A N ARG 188.A O no hydrogen 3.318 N/A ALA 204.A N MET 146.A O no hydrogen 2.995 N/A ARG 205.A N ASP 186.A O no hydrogen 2.850 N/A PHE 206.A N CYS 144.A O no hydrogen 2.905 N/A LEU 208.A N GLN 142.A O no hydrogen 2.914 N/A GLU 209.A N ILE 180.A O no hydrogen 2.915 N/A ARG 210.A N ASP 140.A O no hydrogen 3.432 N/A GLN 211.A N GLN 178.A O no hydrogen 3.164 N/A LEU 216.A N MET 212.A O no hydrogen 2.959 N/A ILE 217.A N GLY 213.A O no hydrogen 2.945 N/A GLN 218.A N TYR 214.A O no hydrogen 2.854 N/A MET 219.A N TYR 215.A O no hydrogen 2.840 N/A TYR 220.A N TYR 215.A O no hydrogen 3.276 N/A TYR 220.A OH TYR 333.A OH no hydrogen 3.405 N/A ILE 221.A N LEU 216.A O no hydrogen 3.256 N/A SER 223.A OG MET 219.A O no hydrogen 3.233 N/A LEU 224.A N TYR 220.A O no hydrogen 2.969 N/A LEU 225.A N ILE 221.A O no hydrogen 2.919 N/A ILE 226.A N PRO 222.A O no hydrogen 2.915 N/A VAL 227.A N SER 223.A O no hydrogen 2.938 N/A ILE 228.A N LEU 224.A O no hydrogen 2.931 N/A LEU 229.A N LEU 225.A O no hydrogen 3.004 N/A SER 230.A OG VAL 227.A O no hydrogen 2.704 N/A VAL 232.A N ILE 228.A O no hydrogen 2.963 N/A SER 233.A N LEU 229.A O no hydrogen 2.935 N/A SER 233.A OG SER 230.A O no hydrogen 2.134 N/A PHE 234.A N SER 230.A O no hydrogen 3.001 N/A ALA 240.A N ASN 237.A OD1 no hydrogen 3.032 N/A ARG 244.A NH2 GLU 292.A OE1 no hydrogen 3.555 N/A VAL 245.A N ALA 241.A O no hydrogen 2.813 N/A GLY 246.A N PRO 242.A O no hydrogen 2.633 N/A LEU 247.A N ALA 243.A O no hydrogen 2.992 N/A GLY 248.A N ARG 244.A O no hydrogen 2.908 N/A ILE 249.A N VAL 245.A O no hydrogen 2.901 N/A THR 250.A N GLY 246.A O no hydrogen 2.910 N/A THR 250.A OG1 GLY 246.A O no hydrogen 2.747 N/A THR 251.A N LEU 247.A O no hydrogen 2.924 N/A THR 251.A OG1 LEU 247.A O no hydrogen 2.496 N/A THR 251.A OG1 GLY 248.A O no hydrogen 2.747 N/A VAL 252.A N GLY 248.A O no hydrogen 2.955 N/A LEU 253.A N ILE 249.A O no hydrogen 2.916 N/A THR 254.A N THR 250.A O no hydrogen 2.923 N/A THR 254.A OG1 THR 250.A O no hydrogen 3.197 N/A THR 254.A OG1 THR 251.A O no hydrogen 2.626 N/A MET 255.A N THR 251.A O no hydrogen 2.915 N/A THR 256.A N VAL 252.A O no hydrogen 2.966 N/A THR 256.A OG1 VAL 252.A O no hydrogen 3.059 N/A THR 257.A N LEU 253.A O no hydrogen 2.955 N/A THR 257.A OG1 LEU 253.A O no hydrogen 3.464 N/A GLN 258.A N THR 254.A O no hydrogen 2.873 N/A SER 259.A N MET 255.A O no hydrogen 2.921 N/A SER 259.A OG MET 255.A O no hydrogen 3.306 N/A SER 259.A OG THR 256.A O no hydrogen 2.219 N/A SER 260.A N THR 256.A O no hydrogen 2.996 N/A SER 260.A OG THR 257.A O no hydrogen 2.657 N/A GLY 261.A N THR 257.A O no hydrogen 2.960 N/A SER 262.A OG SER 259.A O no hydrogen 2.435 N/A ALA 264.A N SER 260.A O no hydrogen 3.049 N/A LEU 266.A N ARG 263.A O no hydrogen 3.270 N/A ASP 276.A N LYS 273.A O no hydrogen 2.904 N/A ILE 277.A N LYS 273.A O no hydrogen 3.350 N/A TRP 278.A N ALA 274.A O no hydrogen 3.020 N/A MET 279.A N ILE 275.A O no hydrogen 2.911 N/A ALA 280.A N ASP 276.A O no hydrogen 2.861 N/A VAL 281.A N ILE 277.A O no hydrogen 2.956 N/A CYS 282.A N TRP 278.A O no hydrogen 3.011 N/A CYS 282.A SG TRP 278.A O no hydrogen 3.144 N/A LEU 283.A N MET 279.A O no hydrogen 2.904 N/A LEU 284.A N ALA 280.A O no hydrogen 2.898 N/A PHE 285.A N VAL 281.A O no hydrogen 2.920 N/A VAL 286.A N CYS 282.A O no hydrogen 3.006 N/A PHE 287.A N LEU 283.A O no hydrogen 2.930 N/A SER 288.A N LEU 284.A O no hydrogen 2.893 N/A SER 288.A OG LEU 284.A O no hydrogen 3.106 N/A SER 288.A OG PHE 285.A O no hydrogen 2.606 N/A ALA 289.A N PHE 285.A O no hydrogen 2.913 N/A LEU 290.A N VAL 286.A O no hydrogen 2.993 N/A LEU 291.A N PHE 287.A O no hydrogen 2.887 N/A GLU 292.A N SER 288.A O no hydrogen 2.885 N/A TYR 293.A N ALA 289.A O no hydrogen 2.983 N/A TYR 293.A OH MET 238.A O no hydrogen 3.050 N/A ALA 294.A N LEU 290.A O no hydrogen 2.909 N/A ALA 295.A N LEU 291.A O no hydrogen 2.939 N/A VAL 296.A N GLU 292.A O no hydrogen 2.925 N/A ASN 297.A N TYR 293.A O no hydrogen 2.928 N/A ASN 297.A ND2 TYR 293.A O no hydrogen 2.302 N/A PHE 298.A N ALA 294.A O no hydrogen 2.909 N/A ILE 299.A N ALA 295.A O no hydrogen 2.969 N/A ALA 300.A N VAL 296.A O no hydrogen 2.851 N/A ARG 301.A N ASN 297.A O no hydrogen 2.645 N/A SER 309.A N LYS 305.A O no hydrogen 2.929 N/A ARG 310.A N LEU 306.A O no hydrogen 2.986 N/A ALA 311.A N PHE 307.A O no hydrogen 2.908 N/A LYS 312.A N ILE 308.A O no hydrogen 2.912 N/A ARG 313.A N SER 309.A O no hydrogen 2.964 N/A ILE 314.A N ARG 310.A O no hydrogen 2.989 N/A ASP 315.A N ALA 311.A O no hydrogen 2.943 N/A THR 316.A OG1 ARG 313.A O no hydrogen 2.743 N/A VAL 317.A N ARG 313.A O no hydrogen 3.029 N/A SER 318.A N ILE 314.A O no hydrogen 2.912 N/A SER 318.A OG ILE 314.A O no hydrogen 2.899 N/A SER 318.A OG ASP 315.A O no hydrogen 2.485 N/A ARG 319.A N ASP 315.A O no hydrogen 2.920 N/A VAL 320.A N THR 316.A O no hydrogen 2.985 N/A ALA 321.A N VAL 317.A O no hydrogen 2.925 N/A PHE 322.A N SER 318.A O no hydrogen 2.907 N/A VAL 325.A N ALA 321.A O no hydrogen 2.924 N/A PHE 326.A N PHE 322.A O no hydrogen 2.944 N/A LEU 327.A N PRO 323.A O no hydrogen 2.903 N/A ILE 328.A N LEU 324.A O no hydrogen 2.885 N/A PHE 329.A N VAL 325.A O no hydrogen 2.959 N/A ASN 330.A N PHE 326.A O no hydrogen 2.907 N/A ILE 331.A N LEU 327.A O no hydrogen 2.940 N/A PHE 332.A N ILE 328.A O no hydrogen 2.954 N/A TYR 333.A N PHE 329.A O no hydrogen 2.821 N/A TYR 333.A OH TYR 220.A OH no hydrogen 3.405 N/A TRP 334.A N ASN 330.A O no hydrogen 2.979 N/A THR 336.A OG1 TYR 333.A O no hydrogen 2.934 N/A LYS 338.A N TRP 334.A O no hydrogen 2.941 N/A LEU 339.A N ILE 335.A O no hydrogen 3.135 N/A